3X3H
Crystal Structure of the Manihot esculenta Hydroxynitrile Lyase (MeHNL) 3KP (K176P, K199P, K224P) triple mutant
Replaces: 3RKTExperimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU FR-E DW |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2010-12-11 |
Detector | RIGAKU RAXIS VII |
Wavelength(s) | 1.5418 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 85.040, 84.210, 134.900 |
Unit cell angles | 90.00, 90.20, 90.00 |
Refinement procedure
Resolution | 15.260 - 2.880 |
R-factor | 0.20597 |
Rwork | 0.204 |
R-free | 0.23785 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1dwp |
RMSD bond length | 0.012 |
RMSD bond angle | 1.506 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | MOLREP |
Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 100.000 | 3.000 |
High resolution limit [Å] | 2.880 | 2.900 |
Number of reflections | 41899 | |
Completeness [%] | 98.3 | 97.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 293 | 25%(v/v) PEG 3350, 0.1M Tris/HCl (pH 8.5), 0.2M Ammonium acetate, VAPOR DIFFUSION, HANGING DROP, temperature 293K |